4098-71-9
Product Name:
Isophorone diisocyanate
Formula:
C12H18N2O2
Synonyms:
5-Isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane;5-Isocyanato-1-isocyanatomethyl-1,3,3-trimethylcyclohexane, 3-Isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate;Isophorone diisocyanate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Isophorone diisocyanate appears as a clear to light-yellow liquid. Slightly denser than water and insoluble in water. Toxic by inhalation and skin absorption. Very irritating to skin. Used to make polyurethane coatings. |
|---|---|
| Color/Form | Colorless to slightly yellow liquid |
| Odor | Pungent |
| Boiling Point | 316 °F at 10 mmHg (NTP, 1992) |
| Melting Point | -76 °F (NTP, 1992) |
| Flash Point | greater than 200 °F (NTP, 1992) |
| Solubility | less than 1 mg/mL at 77 °F (NTP, 1992) |
| Density | 1.056 to 1.062 at 68 °F (USCG, 1999) |
| Vapor Pressure | 0.0003 mmHg at 68 °F ; 0.0007 mmHg at 122 °F (NTP, 1992) |
| LogP | 4.75 (calculated) |
| Autoignition Temperature | 430 °C |
| Decomposition | When heated to decomposition it emits toxic fumes of /nitrogen oxides and hydrogen cyanide/. |
| Chemical Classes | Plastics & Rubber -> Diisocyanates |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
![]() Skull and Crossbones Acute Toxicity GHS06 ![]() Health Hazard GHS08 ![]() Environment GHS09 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H317:Sensitisation, Skin H319:Serious eye damage/eye irritation H330:Acute toxicity,inhalation H334:Sensitisation, respiratory H335:Specific target organ toxicity, single exposure;Respiratory tract irritation H411:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P260:Do not breathe dust/fume/gas/mist/vapours/spray. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
| Molecular Weight | 222.28 g/mol |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 222.136827821 g/mol |
| Monoisotopic Mass | 222.136827821 g/mol |
| Topological Polar Surface Area | 58.9 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 352 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Isophorone diisocyanate appears as a clear to light-yellow liquid. Slightly denser than water and insoluble in water. Toxic by inhalation and skin absorption. Very irritating to skin. Used to make polyurethane coatings.
RELATED SUPPLIERS
Triveni Interchem Private Limited (Group Of Triveni Chemicals)
Gujarat
product:Isophorone Diisocyanate, Drum, Liquid



